Geometry & MOs

Info

ID:	405399
PubChem CID:	135073766
Reduced:	NSO2H21C24 (1)
Stoich.:	ABC2D21E24 (1)
Weight, g/mol:	321.025819
ΔH_f, kcal/mol:	-5.73
Dipole, Da:	5.73
IP(EA), eV:	-8.52(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoro-N-[2-[2-(trifluoromethyl)phenyl]ethyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C)C3=CC=CC4=CC=CC=C43

DOS

IR

Vibrations